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2-methoxy-5-((E)-{[2-(1H-pyrrol-1-yl)benzoyl]hydrazono}methyl)phenyl 4-methoxybenzoate
SpectraBase Compound ID v2h6OIRP51
InChI InChI=1S/C27H23N3O5/c1-33-21-12-10-20(11-13-21)27(32)35-25-17-19(9-14-24(25)34-2)18-28-29-26(31)22-7-3-4-8-23(22)30-15-5-6-16-30/h3-18H,1-2H3,(H,29,31)/b28-18+
InChIKey JDZJPWWEJCVTPP-MTDXEUNCSA-N
Mol Weight 469.5 g/mol
Molecular Formula C27H23N3O5
Exact Mass 469.163771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ltz5QaG6BYg
Name 2-Methoxy-5-((E)-{[2-(1H-pyrrol-1-yl)benzoyl]hydrazono}methyl)phenyl 4-methoxybenzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 469.163770848 u
Formula C27H23N3O5
InChI InChI=1S/C27H23N3O5/c1-33-21-12-10-20(11-13-21)27(32)35-25-17-19(9-14-24(25)34-2)18-28-29-26(31)22-7-3-4-8-23(22)30-15-5-6-16-30/h3-18H,1-2H3,(H,29,31)/b28-18+
InChIKey JDZJPWWEJCVTPP-MTDXEUNCSA-N
Molecular Weight 469.497 g/mol
SMILES N(\N=C\C1=CC(OC(C2=CC=C(C=C2)OC)=O)=C(C=C1)OC)C(C=1C(N2C=CC=C2)=CC=CC1)=O